Geometry & MOs

Info

ID:	227188
PubChem CID:	87560494
Reduced:	OC15H28 (1)
Stoich.:	AB15C28 (1)
Weight, g/mol:	233.177964
ΔH_f, kcal/mol:	-58.29
Dipole, Da:	1.71
IP(EA), eV:	-9.54(1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-butylanilino)pentanal

Drug info:

PubChemData

Smile

CCCCCCCCC(C)C(C)(C)C#CO

DOS

IR

Vibrations